methyl 4-methyl-2-[2-(2-naphthalen-2-ylsulfanylethanoyloxy)ethanoylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[2-(2-naphthalen-2-ylsulfanylethanoyloxy)ethanoylamino]pentanoate Openeye Name: methyl 4-methyl-2-[[2-[2-(2-naphthylsulfanyl)acetyl]oxyacetyl]amino]pentanoate CAS Name: 4-methyl-2-[[2-[2-(2-naphthalenylthio)-1-oxoethoxy]-1-oxoethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-(2-naphthalen-2-ylsulfanylacetyl)oxyacetyl]amino]pentanoate Traditional Name: 4-methyl-2-[[2-[2-(2-naphthylthio)acetyl]oxyacetyl]amino]valeric acid methyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)COC(=O)CSC1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)COC(=O)CSC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C21H25NO5S/c1-14(2)10-18(21(25)26-3)22-19(23)12-27-20(24)13-28-17-9-8-15-6-4-5-7-16(15)11-17/h4-9,11,14,18H,10,12-13H2,1-3H3,(H,22,23)